2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide

C18H18ClFN2O3 — CID 7943410

IUPAC2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide
SMILESCc1ccc(C)c(OCC(=O)NNC(=O)Cc2c(F)cccc2Cl)c1
InChIInChI=1S/C18H18ClFN2O3/c1-11-6-7-12(2)16(8-11)25-10-18(24)22-21-17(23)9-13-14(19)4-3-5-15(13)20/h3-8H,9-10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGNRACYWQNXJRSW-UHFFFAOYSA-N
MW364.80 g/mol
LogP2.86
Rot. Bonds5

About 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide

2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide (PubChem CID 7943410) has the molecular formula C18H18ClFN2O3 and a molecular weight of 364.80 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide
PubChem CID7943410
Molecular FormulaC18H18ClFN2O3
Molecular Weight364.80 g/mol
Exact Mass364.10
IUPAC Name2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide
SMILESCc1ccc(C)c(OCC(=O)NNC(=O)Cc2c(F)cccc2Cl)c1
InChIInChI=1S/C18H18ClFN2O3/c1-11-6-7-12(2)16(8-11)25-10-18(24)22-21-17(23)9-13-14(19)4-3-5-15(13)20/h3-8H,9-10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGNRACYWQNXJRSW-UHFFFAOYSA-N
XLogP2.86
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.80
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-chloro-6-fluorophenyl)-N'-[2-(3,5-dimethylphenoxy)acetyl]acetohydrazide
CID 30544669
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(2-fluorophenoxy)acetohydrazide
CID 7943429
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(3-fluorophenyl)acetohydrazide
CID 27568831
N'-(2-chloroacetyl)-2-(2,5-dimethylphenoxy)acetohydrazide
CID 166414788
N'-acetyl-2-(2-chloro-6-fluorophenyl)acetohydrazide
CID 30905798
N-[2-[1-[(2-chloro-6-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-(2,5-dimethylphenoxy)acetamide
CID 16978626
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-methoxyacetohydrazide
CID 47102429
N'-[2-(2,5-dimethylphenoxy)acetyl]-3-methylbenzohydrazide
CID 965967
2-(2-chloro-6-fluorophenyl)-N-(4-methylphenyl)acetamide
CID 2112014
N'-[2-(2,5-dimethylphenoxy)acetyl]-2,3,4,5-tetrafluorobenzohydrazide
CID 3442692
2-(2-chloro-6-fluorophenyl)-1-(2,4-dimethylphenyl)ethanone
CID 43337883
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(4-ethoxyphenyl)acetohydrazide
CID 27568812

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide (CID 7943410) is 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide is Cc1ccc(C)c(OCC(=O)NNC(=O)Cc2c(F)cccc2Cl)c1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide?
The InChIKey is GNRACYWQNXJRSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClFN2O3/c1-11-6-7-12(2)16(8-11)25-10-18(24)22-21-17(23)9-13-14(19)4-3-5-15(13)20/h3-8H,9-10H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide?
2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide has a molecular weight of 364.80 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N'-[2-(2,5-dimethylphenoxy)acetyl]acetohydrazide is sourced from PubChem (CID 7943410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).